4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine

C16H22N4 — CID 134278508

IUPAC4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine
SMILESCC(C)n1ncc2c1C(N)CCN2Cc1ccccc1
InChIInChI=1S/C16H22N4/c1-12(2)20-16-14(17)8-9-19(15(16)10-18-20)11-13-6-4-3-5-7-13/h3-7,10,12,14H,8-9,11,17H2,1-2H3
InChIKeyGFMGQAVHWFWJSG-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.87
Rot. Bonds3

About 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine

4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine (PubChem CID 134278508) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine
PubChem CID134278508
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine
SMILESCC(C)n1ncc2c1C(N)CCN2Cc1ccccc1
InChIInChI=1S/C16H22N4/c1-12(2)20-16-14(17)8-9-19(15(16)10-18-20)11-13-6-4-3-5-7-13/h3-7,10,12,14H,8-9,11,17H2,1-2H3
InChIKeyGFMGQAVHWFWJSG-UHFFFAOYSA-N
XLogP2.87
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine?
The IUPAC name of 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine (CID 134278508) is 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine?
The canonical SMILES for 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine is CC(C)n1ncc2c1C(N)CCN2Cc1ccccc1.
What is the InChIKey of 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine?
The InChIKey is GFMGQAVHWFWJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-12(2)20-16-14(17)8-9-19(15(16)10-18-20)11-13-6-4-3-5-7-13/h3-7,10,12,14H,8-9,11,17H2,1-2H3.
What are the key properties of 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine?
4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine has a molecular weight of 270.38 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-1-propan-2-yl-6,7-dihydro-5H-pyrazolo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 134278508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).